3-phenyl-1-piperidin-1-ium-4-yl-2H-imidazo[5,1-b][1,3]benzothiazol-9-ium

Systemtic Name: 3-phenyl-1-piperidin-1-ium-4-yl-2H-imidazo[5,1-b][1,3]benzothiazol-9-ium Openeye Name: 3-phenyl-1-piperidin-1-ium-4-yl-2H-imidazo[5,1-b][1,3]benzothiazol-9-ium CAS Name: 3-phenyl-1-(4-piperidin-1-iumyl)-2H-imidazo[5,1-b][1,3]benzothiazol-9-ium IUPAC Name: 3-phenyl-1-piperidin-1-ium-4-yl-2H-imidazo[5,1-b][1,3]benzothiazol-9-ium Traditional Name: 3-phenyl-1-piperidin-1-ium-4-yl-2H-imidazo[5,1-b][1,3]benzothiazol-9-ium Formula: C20H21N3S+2 MolecularWeight: 335.46584

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCC1C2=[N+]3C4=CC=CC=C4SC3=C(N2)C5=CC=CC=C5

Isomeric SMILES

C1C[NH2+]CCC1C2=[N+]3C4=CC=CC=C4SC3=C(N2)C5=CC=CC=C5

InChI

InChI=1S/C20H19N3S/c1-2-6-14(7-3-1)18-20-23(16-8-4-5-9-17(16)24-20)19(22-18)15-10-12-21-13-11-15/h1-9,15,21H,10-13H2/p+2